KEGG:C08604 Cyanidin 3-O-glucoside ISISHOST03240423202D 1 1.00000 0.00000 7644 32 35 0 0 0 999 V2000 -0.6448 0.7862 0.0000 C 0 0 0 0 0 0 0 0 0 -0.6483 -0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0.0759 1.2000 0.0000 C 0 0 0 0 0 0 0 0 0 -1.3586 1.2069 0.0000 O 0 3 0 0 0 0 0 0 0 0.0034 -0.4172 0.0000 O 0 0 0 0 0 0 0 0 0 -1.3655 -0.4517 0.0000 C 0 0 0 0 0 0 0 0 0 0.7931 0.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0.0759 2.0310 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0793 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 0.7793 -0.8724 0.0000 C 0 0 2 0 0 0 0 0 0 -2.0828 -0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 1.5138 1.1966 0.0000 C 0 0 0 0 0 0 0 0 0 0.7966 2.4448 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7966 1.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0.7793 -1.6965 0.0000 O 0 0 0 0 0 0 0 0 0 1.4966 -0.4586 0.0000 C 0 0 1 0 0 0 0 0 0 -2.7966 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 1.5172 2.0276 0.0000 C 0 0 0 0 0 0 0 0 0 2.2276 0.7828 0.0000 O 0 0 0 0 0 0 0 0 0 -3.5138 0.7931 0.0000 C 0 0 0 0 0 0 0 0 0 1.4966 -2.1103 0.0000 C 0 0 1 0 0 0 0 0 0 2.2069 -0.8724 0.0000 C 0 0 2 0 0 0 0 0 0 1.4966 0.3655 0.0000 O 0 0 0 0 0 0 0 0 0 -3.5138 -0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 -2.7966 -1.2724 0.0000 O 0 0 0 0 0 0 0 0 0 2.2310 2.4379 0.0000 O 0 0 0 0 0 0 0 0 0 -4.2276 1.2034 0.0000 O 0 0 0 0 0 0 0 0 0 2.2069 -1.6965 0.0000 C 0 0 2 0 0 0 0 0 0 1.4966 -2.9345 0.0000 C 0 0 0 0 0 0 0 0 0 2.9241 -0.4586 0.0000 O 0 0 0 0 0 0 0 0 0 2.9241 -2.1069 0.0000 O 0 0 0 0 0 0 0 0 0 0.7828 -3.3483 0.0000 O 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 2 0 0 0 2 5 1 0 0 0 2 6 2 0 0 0 3 7 2 0 0 0 3 8 1 0 0 0 4 9 1 0 0 0 10 5 1 1 0 0 6 11 1 0 0 0 7 12 1 0 0 0 8 13 2 0 0 0 9 14 1 0 0 0 10 15 1 0 0 0 10 16 1 0 0 0 11 17 1 0 0 0 12 18 2 0 0 0 12 19 1 0 0 0 14 20 2 0 0 0 15 21 1 0 0 0 16 22 1 0 0 0 16 23 1 6 0 0 17 24 2 0 0 0 17 25 1 0 0 0 18 26 1 0 0 0 20 27 1 0 0 0 21 28 1 0 0 0 21 29 1 1 0 0 22 30 1 1 0 0 28 31 1 6 0 0 29 32 1 0 0 0 9 11 2 0 0 0 13 18 1 0 0 0 20 24 1 0 0 0 22 28 1 0 0 0 M CHG 1 4 1 M END